2-[(1E)-cyclododecen-1-yl]non-3-yn-2-ol

Systemtic Name: 2-[(1E)-cyclododecen-1-yl]non-3-yn-2-ol Openeye Name: 2-[(1E)-cyclododecen-1-yl]non-3-yn-2-ol CAS Name: 2-[(1E)-1-cyclododecenyl]-3-nonyn-2-ol IUPAC Name: 2-[(1E)-cyclododecen-1-yl]non-3-yn-2-ol Traditional Name: 2-[(1E)-cyclododecen-1-yl]non-3-yn-2-ol Formula: C21H36O MolecularWeight: 304.50994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC(C)(C1=CCCCCCCCCCC1)O

Isomeric SMILES

CCCCCC#CC(C)(/C/1=C/CCCCCCCCCC1)O

InChI

InChI=1S/C21H36O/c1-3-4-5-13-16-19-21(2,22)20-17-14-11-9-7-6-8-10-12-15-18-20/h17,22H,3-15,18H2,1-2H3/b20-17+